Vitas-M small molecule compound
N-(4-acetylphenyl)-2-{[6-methyl-3-(2-methylpropyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093550
SMILES CC(Cn1c(SCC(=O)Nc2ccc(cc2)C(=O)C)nc2c(c1=O)[nH]c(c2)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H24N4O3S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S/c1-12(2)10-25-20(28)19-17(9-13(3)22-19)24-21(25)29-11-18(27)23-16-7-5-15(6-8-16)14(4)26/h5-9,12,22H,10-11H2,1-4H3,(H,23,27)InChIKey
JOOLEAMGLRGGBD-UHFFFAOYSA-NSynonyms
CC(Cn1c(SCC(=O)Nc2ccc(cc2)C(=O)C)nc2c(c1=O)(nH)c(c2)C)C
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)C(=O)C)CC(C)C
InChI=1SC21H24N4O3Sc112(2)102520(28)1917(913(3)2219)2421(25)291118(27)23167515(6816)14(4)26h591222H1011H214H3(H2327)
MFCD18787684
N(4acetylphenyl)2((6methyl3(2methylpropyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4acetylphenyl)2((6methyl3(2methylpropyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237791
ZINC67237791
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